Vitas-M small molecule compound

N'-[3-(4-methylphenyl)-4-oxo-4,6-dihydro-3H-spiro[benzo[h]quinazoline-5,1'-cyclohexan]-2-yl]propanehydrazide

Catalog ID
STK530352
SMILES CCC(=O)NNc1nc2c3ccccc3CC3(c2c(=O)n1c1ccc(cc1)C)CCCCC3

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We supply compounds in quantities from 1 mg up to 5 g for research and development purposes only.

We do not supply quantities above 5 g.

Structure and other identifiers

2D representation rendered from the SMILES, with core physicochemical data.
Formula C27H30N4O2 MW 442.56 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H30N4O2/c1-3-22(32)29-30-26-28-24-21-10-6-5-9-19(21)17-27(15-7-4-8-16-27)23(24)25(33)31(26)20-13-11-18(2)12-14-20/h5-6,9-14H,3-4,7-8,15-17H2,1-2H3,(H,28,30)(H,29,32)
InChIKey
PKZDCSUCPSLIDP-UHFFFAOYSA-N
Synonyms

CCC(=O)NNC1=NC2=C(C(=O)N1C3=CC=C(C=C3)C)C4(CCCCC4)CC5=CC=CC=C52
InChI=1SC27H30N4O2c1322(32)2930262824211065919(21)1727(157481627)23(24)25(33)31(26)20131118(2)121420h56914H34781517H212H3(H2830)(H2932)
MFCD01992971
N(3(4methylphenyl)4oxo46dihydro3Hspiro(benzo(h)quinazoline51cyclohexan)2yl)propanehydrazide
N(3(4METHYLPHENYL)4OXOSPIRO(6HBENZO(H)QUINAZOLINE51CYCLOHEXANE)2YL)PROPANEHYDRAZIDE
N(4oxo3(ptolyl)46dihydro3Hspiro(benzo(h)quinazoline51cyclohexan)2yl)propionohydrazide
ZINC000002294382
ZINC02294382
ZINC2294382

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.